Asterriquinone
[CAS# 60696-52-8]

Identification

• Name: Asterriquinone
• Synonyms: 2,5-Bis[1-(1,1-Dimethylprop-2-Enyl)Indol-3-Yl]-3,6-Dihydroxy-1,4-Benzoquinone; 2,5-Bis[1-(1,1-Dimethylprop-2-Enyl)-3-Indolyl]-3,6-Dihydroxy-1,4-Benzoquinone; 2,5-Bis[1-(1,1-Dimethylprop-2-Enyl)Indol-3-Yl]-3,6-Dihydroxy-P-Benzoquinone
• Molecular Formula: C₃₂H₃₀N₂O₄
• Molecular Weight: 506.60
• CAS Registry Number: 60696-52-8
• SMILES: C5=C(C1=C(C(=O)C(=C(C1=O)O)C2=C[N](C(C=C)(C)C)C3=C2C=CC=C3)O)C4=C(C=CC=C4)[N]5C(C=C)(C)C
• InChI: 1S/C32H30N2O4/c1-7-31(3,4)33-17-21(19-13-9-11-15-23(19)33)25-27(35)29(37)26(30(38)28(25)36)22-18-34(32(5,6)8-2)24-16-12-10-14-20(22)24/h7-18,35,38H,1-2H2,3-6H3
• InChIKey: KMHWTYMNRHJTQG-UHFFFAOYSA-N

Properties

• Density: 1.204g/cm³ (Cal.)
• Boiling point: 726.151°C at 760 mmHg (Cal.)
• Flash point: 392.962°C (Cal.)

References

• (1): Fletcher Anthony J.. Palladium-catalysed N-annulation routes to indoles: the synthesis of indoles with sterically demanding N-substituents, including demethylasterriquinone A1, Chemical Communications, 2007